ADA-UCB-6c2cb422-1

Data

Transformations

RUN	Initial microstate				Final microstate				ΔΔG / kcal M-1	Work distributions	Convergence
RUN509	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-56cf811e-1_1		sdf	pdb	−7.3 ± 0.3
RUN518	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-12d8d43f-2_1		sdf	pdb	−7.2 ± 0.3
RUN92	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-9f475305-8_2		sdf	pdb	−5.3 ± 0.8
RUN501	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-7_2		sdf	pdb	−4.9 ± 0.3
RUN641	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-16_1		sdf	pdb	−4.5 ± 0.2
RUN345	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-a692de38-1_1		sdf	pdb	−4.3 ± 0.3
RUN611	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-e8c7a26f-2_1		sdf	pdb	−4.2 ± 0.3
RUN310	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-13_1		sdf	pdb	−3.5 ± 0.2
RUN244	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-d36ab305-4_2		sdf	pdb	−3.5 ± 0.3
RUN450	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-67d4a29a-4_1		sdf	pdb	−3.3 ± 0.4
RUN513	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-7_3		sdf	pdb	−3.2 ± 0.2
RUN732	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-21_1		sdf	pdb	−3.2 ± 0.4
RUN743	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-29_1		sdf	pdb	−3.2 ± 0.5
RUN556	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-7_2		sdf	pdb	−3.1 ± 0.5
RUN87	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-9f475305-8_1		sdf	pdb	−3.0 ± 0.3
RUN52	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-2_1		sdf	pdb	−2.9 ± 0.1
RUN510	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-12d8d43f-1_1		sdf	pdb	−2.7 ± 0.2
RUN194	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-3b848b35-4_2		sdf	pdb	−2.7 ± 0.4
RUN447	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-67d4a29a-1_1		sdf	pdb	−2.5 ± 0.5
RUN145	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-3_2		sdf	pdb	−2.4 ± 0.2
RUN515	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-7_4		sdf	pdb	−2.4 ± 0.3
RUN304	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-7_1		sdf	pdb	−2.4 ± 0.3
RUN322	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-5ecb6237-1_1		sdf	pdb	−2.4 ± 0.2
RUN498	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-5_1		sdf	pdb	−2.2 ± 0.5
RUN439	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-12_7		sdf	pdb	−2.1 ± 0.2
RUN240	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-d36ab305-1_1		sdf	pdb	−2.1 ± 0.4
RUN435	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-12_1		sdf	pdb	−2.1 ± 0.3
RUN593	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-16_1		sdf	pdb	−2.1 ± 0.3
RUN335	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-97c1bf5c-2_1		sdf	pdb	−2.0 ± 0.3
RUN278	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bfb445d4-2_1		sdf	pdb	−2.0 ± 0.2
RUN483	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-15_1		sdf	pdb	−2.0 ± 0.3
RUN737	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-9_1		sdf	pdb	−2.0 ± 0.4
RUN248	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-c66144cb-1_2		sdf	pdb	−1.9 ± 0.4
RUN595	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-11_7		sdf	pdb	−1.9 ± 0.3
RUN590	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-11_3		sdf	pdb	−1.9 ± 0.3
RUN393	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-4_6		sdf	pdb	−1.8 ± 0.3
RUN745	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-26_1		sdf	pdb	−1.7 ± 0.5
RUN625	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-3_2		sdf	pdb	−1.7 ± 0.4
RUN602	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-17_1		sdf	pdb	−1.7 ± 0.4
RUN574	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-8_1		sdf	pdb	−1.7 ± 0.3
RUN610	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-12_1		sdf	pdb	−1.7 ± 0.3
RUN20	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-7_1		sdf	pdb	−1.7 ± 0.3
RUN635	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-15_1		sdf	pdb	−1.7 ± 0.1
RUN311	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-17_1		sdf	pdb	−1.7 ± 0.1
RUN202	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-20_2		sdf	pdb	−1.7 ± 0.3
RUN542	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-7_2		sdf	pdb	−1.6 ± 0.4
RUN674	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-18_1		sdf	pdb	−1.64 ± 0.06
RUN716	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-5_2		sdf	pdb	−1.6 ± 0.3
RUN497	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-5_3		sdf	pdb	−1.6 ± 0.4
RUN64	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-9f475305-3_2		sdf	pdb	−1.6 ± 0.2
RUN66	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-4_1		sdf	pdb	−1.6 ± 0.2
RUN171	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-3fc1724e-8_2		sdf	pdb	−1.6 ± 0.5
RUN582	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-10_1		sdf	pdb	−1.6 ± 0.3
RUN49	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-9_1		sdf	pdb	−1.6 ± 0.2
RUN461	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-5_1		sdf	pdb	−1.5 ± 0.5
RUN569	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-3_2		sdf	pdb	−1.5 ± 0.3
RUN578	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-9_2		sdf	pdb	−1.5 ± 0.3
RUN581	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UNK-9a7dc93f-7_1		sdf	pdb	−1.45 ± 0.06
RUN296	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-1_1		sdf	pdb	−1.4 ± 0.2
RUN586	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-11_1		sdf	pdb	−1.4 ± 0.4
RUN443	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-12_3		sdf	pdb	−1.3 ± 0.3
RUN473	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-9_2		sdf	pdb	−1.3 ± 0.6
RUN566	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-1_2		sdf	pdb	−1.3 ± 0.2
RUN685	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UNK-411a133b-1_1		sdf	pdb	−1.3 ± 0.2
RUN201	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-18_2		sdf	pdb	−1.3 ± 0.3
RUN245	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-c66144cb-2_2		sdf	pdb	−1.3 ± 0.4
RUN684	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UNK-dc1d9354-1_1		sdf	pdb	−1.2 ± 0.2
RUN159	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-17_1		sdf	pdb	−1.2 ± 0.2
RUN168	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UCB-6c2cb422-8_1		sdf	pdb	−1.2 ± 0.6
RUN535	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-6_2		sdf	pdb	−1.2 ± 0.2
RUN39	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-95b75b4d-6_1		sdf	pdb	−1.2 ± 0.3
RUN617	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-a13804f0-1_3		sdf	pdb	−1.1 ± 0.3
RUN702	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-6314f867-3_1		sdf	pdb	−1.1 ± 0.2
RUN405	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-4_8		sdf	pdb	−1.1 ± 0.3
RUN454	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-22_6		sdf	pdb	−1.1 ± 0.3
RUN612	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-4_4		sdf	pdb	−1.1 ± 0.3
RUN608	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-18_2		sdf	pdb	−1.0 ± 0.3
RUN650	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-17_1		sdf	pdb	−1.0 ± 0.2
RUN728	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-7_1		sdf	pdb	−1.0 ± 0.4
RUN60	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-6_1		sdf	pdb	−1.0 ± 0.2
RUN524	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-56cf811e-4_1		sdf	pdb	−1.0 ± 0.3
RUN672	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-17_1		sdf	pdb	−1.00 ± 0.05
RUN583	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-6_4		sdf	pdb	−1.0 ± 0.3
RUN547	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-6_2		sdf	pdb	−1.0 ± 0.2
RUN482	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-6_4		sdf	pdb	−1.0 ± 0.5
RUN731	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-22_1		sdf	pdb	−1.0 ± 0.3
RUN598	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-11_5		sdf	pdb	−1.0 ± 0.4
RUN627	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-3_1		sdf	pdb	−0.9 ± 0.3
RUN69	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-9f475305-3_1		sdf	pdb	−0.9 ± 0.3
RUN567	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-2_2		sdf	pdb	−0.9 ± 0.3
RUN257	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-7_1		sdf	pdb	−0.8 ± 0.6
RUN741	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-6_1		sdf	pdb	−0.8 ± 0.3
RUN396	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_11		sdf	pdb	−0.8 ± 0.3
RUN703	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-1_1		sdf	pdb	−0.7 ± 0.3
RUN575	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-7_2		sdf	pdb	−0.7 ± 0.4
RUN484	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-6_3		sdf	pdb	−0.7 ± 0.5
RUN486	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-8_4		sdf	pdb	−0.6 ± 0.3
RUN584	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-6_3		sdf	pdb	−0.6 ± 0.3
RUN480	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-7_1		sdf	pdb	−0.6 ± 0.3
RUN147	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-bbe8d7ff-1_1		sdf	pdb	−0.6 ± 0.3
RUN451	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-67d4a29a-2_1		sdf	pdb	−0.6 ± 0.8
RUN648	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-2_1		sdf	pdb	−0.6 ± 0.7
RUN599	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-15_1		sdf	pdb	−0.6 ± 0.4
RUN50	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-1_1		sdf	pdb	−0.5 ± 0.2
RUN474	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-22_8		sdf	pdb	−0.5 ± 0.4
RUN356	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-2_3		sdf	pdb	−0.5 ± 0.4
RUN362	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-5_1		sdf	pdb	−0.5 ± 0.3
RUN736	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-3_1		sdf	pdb	−0.5 ± 0.3
RUN738	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-10_1		sdf	pdb	−0.5 ± 0.4
RUN262	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-8_1		sdf	pdb	−0.5 ± 0.2
RUN536	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-5_1		sdf	pdb	−0.4 ± 0.4
RUN462	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-4ce8bf23-2_1		sdf	pdb	−0.4 ± 0.4
RUN607	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-5_1		sdf	pdb	−0.4 ± 0.4
RUN389	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_3		sdf	pdb	−0.4 ± 0.4
RUN723	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-a9ad2217-2_1		sdf	pdb	−0.4 ± 0.4
RUN415	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-6_1		sdf	pdb	−0.4 ± 0.3
RUN740	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-27_1		sdf	pdb	−0.4 ± 0.4
RUN622	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-4_2		sdf	pdb	−0.4 ± 0.2
RUN528	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-6c2be958-1_1		sdf	pdb	−0.4 ± 0.3
RUN299	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-05e51b3f-15_1		sdf	pdb	−0.4 ± 0.3
RUN301	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-8_1		sdf	pdb	−0.4 ± 0.3
RUN453	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-2fed8305-1_1		sdf	pdb	−0.31 ± 0.08
RUN204	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-18_1		sdf	pdb	−0.3 ± 0.3
RUN340	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-50cce87d-3_1		sdf	pdb	−0.3 ± 0.1
RUN733	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-5_1		sdf	pdb	−0.3 ± 0.4
RUN729	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-2_1		sdf	pdb	−0.3 ± 0.3
RUN620	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-a13804f0-4_1		sdf	pdb	−0.2 ± 0.4
RUN272	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-1e5f28a7-1_1		sdf	pdb	−0.2 ± 0.2
RUN363	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-9_3		sdf	pdb	−0.2 ± 0.3
RUN140	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-3_1		sdf	pdb	−0.2 ± 0.2
RUN334	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-6_2		sdf	pdb	−0.2 ± 0.6
RUN492	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-3_1		sdf	pdb	−0.2 ± 0.2
RUN603	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-17_2		sdf	pdb	−0.2 ± 0.3
RUN564	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-1_1		sdf	pdb	−0.2 ± 0.3
RUN592	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-11_6		sdf	pdb	−0.2 ± 0.4
RUN719	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-158bee2a-2_1		sdf	pdb	−0.2 ± 0.2
RUN338	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-50cce87d-2_1		sdf	pdb	−0.1 ± 0.2
RUN269	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-f7918075-5_1		sdf	pdb	−0.15 ± 0.03
RUN221	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-c66144cb-3_2		sdf	pdb	−0.1 ± 0.5
RUN594	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-13_2		sdf	pdb	−0.1 ± 0.4
RUN601	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-14_2		sdf	pdb	−0.1 ± 0.4
RUN521	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-56cf811e-3_1		sdf	pdb	−0.1 ± 0.7
RUN639	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-11_1		sdf	pdb	−0.1 ± 0.2
RUN689	ADA-UCB-6c2cb422-1_1		sdf	pdb	ROB-UNI-daaf9793-3_1		sdf	pdb	−0.1 ± 0.2
RUN206	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-8df914d1-1_1		sdf	pdb	−0.1 ± 0.2
RUN90	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-9f475305-7_1		sdf	pdb	−0.1 ± 0.4
RUN487	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-1_1		sdf	pdb	−0.1 ± 0.3
RUN597	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-11_8		sdf	pdb	−0.1 ± 0.4
RUN200	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-19_2		sdf	pdb	−0.1 ± 0.3
RUN390	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_1		sdf	pdb	−0.0 ± 0.3
RUN708	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f4e47ebd-2_1		sdf	pdb	−0.0 ± 0.2
RUN152	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UCB-6c2cb422-1_1		sdf	pdb	−0.01 ± 0.03
RUN392	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-4_5		sdf	pdb	−0.0 ± 0.5
RUN606	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-18_1		sdf	pdb	−0.0 ± 0.4
RUN730	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-4_1		sdf	pdb	0.0 ± 0.4
RUN713	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-076d6e64-1_1		sdf	pdb	0.0 ± 0.2
RUN19	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-6_2		sdf	pdb	0.0 ± 0.2
RUN264	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-f7918075-3_1		sdf	pdb	0.05 ± 0.07
RUN255	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-1_1		sdf	pdb	0.05 ± 0.04
RUN478	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-10_2		sdf	pdb	0.0 ± 0.3
RUN413	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-1_3		sdf	pdb	0.1 ± 0.5
RUN344	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-50cce87d-1_1		sdf	pdb	0.06 ± 0.02
RUN218	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-08cd9c58-1_1		sdf	pdb	0.09 ± 0.06
RUN144	ADA-UCB-6c2cb422-1_1		sdf	pdb	ABI-SAT-4d06482b-2_1		sdf	pdb	0.1 ± 0.1
RUN577	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-9_1		sdf	pdb	0.1 ± 0.4
RUN350	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-1_1		sdf	pdb	0.1 ± 0.3
RUN724	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-10339a1d-1_1		sdf	pdb	0.1 ± 0.3
RUN712	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-b1ef24dc-3_1		sdf	pdb	0.1 ± 0.3
RUN537	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-3_1		sdf	pdb	0.2 ± 0.2
RUN720	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-158bee2a-4_1		sdf	pdb	0.2 ± 0.2
RUN640	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-13_1		sdf	pdb	0.19 ± 0.06
RUN506	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-3_1		sdf	pdb	0.2 ± 0.3
RUN653	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-4_1		sdf	pdb	0.2 ± 0.2
RUN655	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-2_1		sdf	pdb	0.24 ± 0.03
RUN157	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-14_1		sdf	pdb	0.2 ± 0.2
RUN591	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-11_4		sdf	pdb	0.3 ± 0.4
RUN277	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-14ad9fe9-1_1		sdf	pdb	0.3 ± 0.2
RUN670	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-8_1		sdf	pdb	0.3 ± 0.2
RUN557	ADA-UCB-6c2cb422-1_1		sdf	pdb	RAL-THA-2d450e86-19_1		sdf	pdb	0.26 ± 0.05
RUN139	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-6_2		sdf	pdb	0.3 ± 0.1
RUN402	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_13		sdf	pdb	0.3 ± 0.3
RUN479	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-22_7		sdf	pdb	0.3 ± 0.5
RUN649	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-3_1		sdf	pdb	0.3 ± 0.1
RUN572	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-3_1		sdf	pdb	0.3 ± 0.3
RUN721	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-7574fcc6-1_1		sdf	pdb	0.3 ± 0.3
RUN107	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAG-UCB-a3ef7265-10_1		sdf	pdb	0.3 ± 0.2
RUN387	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_9		sdf	pdb	0.3 ± 0.3
RUN571	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-2_1		sdf	pdb	0.3 ± 0.4
RUN734	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-8_1		sdf	pdb	0.3 ± 0.4
RUN700	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-6314f867-2_1		sdf	pdb	0.4 ± 0.3
RUN75	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-15_1		sdf	pdb	0.4 ± 0.3
RUN445	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-12_5		sdf	pdb	0.4 ± 0.2
RUN587	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-13_1		sdf	pdb	0.4 ± 0.3
RUN214	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8971c93c-1_1		sdf	pdb	0.4 ± 0.2
RUN189	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-00c1612e-1_1		sdf	pdb	0.4 ± 0.2
RUN29	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-9_1		sdf	pdb	0.5 ± 0.2
RUN279	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-afd4d4fd-3_1		sdf	pdb	0.49 ± 0.07
RUN727	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-1_1		sdf	pdb	0.5 ± 0.3
RUN151	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-18_1		sdf	pdb	0.5 ± 0.3
RUN551	ADA-UCB-6c2cb422-1_1		sdf	pdb	RAL-THA-2d450e86-20_1		sdf	pdb	0.52 ± 0.07
RUN555	ADA-UCB-6c2cb422-1_1		sdf	pdb	RAL-THA-2d450e86-21_1		sdf	pdb	0.5 ± 0.1
RUN507	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-6_3		sdf	pdb	0.5 ± 0.3
RUN600	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-16_2		sdf	pdb	0.5 ± 0.2
RUN195	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-20_1		sdf	pdb	0.5 ± 0.3
RUN288	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-8b8a49e1-6_1		sdf	pdb	0.6 ± 0.2
RUN705	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-1_2		sdf	pdb	0.6 ± 0.4
RUN433	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-7_7		sdf	pdb	0.6 ± 0.4
RUN74	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-8_1		sdf	pdb	0.6 ± 0.5
RUN673	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-14_1		sdf	pdb	0.6 ± 0.2
RUN260	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-2_1		sdf	pdb	0.6 ± 0.1
RUN158	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UCB-6c2cb422-11_1		sdf	pdb	0.6 ± 0.4
RUN505	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-4_1		sdf	pdb	0.6 ± 0.5
RUN62	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-14_1		sdf	pdb	0.6 ± 0.3
RUN358	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-1_3		sdf	pdb	0.6 ± 0.3
RUN440	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-7_8		sdf	pdb	0.6 ± 0.3
RUN661	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-12_1		sdf	pdb	0.6 ± 0.2
RUN576	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-8_2		sdf	pdb	0.6 ± 0.4
RUN715	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-b1ef24dc-2_1		sdf	pdb	0.6 ± 0.2
RUN114	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-4_1		sdf	pdb	0.6 ± 0.5
RUN178	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-fc94cdb5-1_2		sdf	pdb	0.7 ± 0.3
RUN725	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-10339a1d-1_2		sdf	pdb	0.7 ± 0.3
RUN265	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-9_1		sdf	pdb	0.67 ± 0.06
RUN711	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-b1ef24dc-1_1		sdf	pdb	0.7 ± 0.3
RUN704	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UNK-4cf5aa07-2_1		sdf	pdb	0.7 ± 0.2
RUN349	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-2_5		sdf	pdb	0.7 ± 0.4
RUN352	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-2_1		sdf	pdb	0.7 ± 0.3
RUN203	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-19_1		sdf	pdb	0.7 ± 0.3
RUN624	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-a13804f0-4_2		sdf	pdb	0.7 ± 0.4
RUN300	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-4_1		sdf	pdb	0.8 ± 0.3
RUN22	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-8_2		sdf	pdb	0.8 ± 0.3
RUN315	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-199e2e7c-2_1		sdf	pdb	0.8 ± 0.2
RUN275	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-afd4d4fd-1_1		sdf	pdb	0.79 ± 0.09
RUN432	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-7_5		sdf	pdb	0.8 ± 0.4
RUN79	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-2_1		sdf	pdb	0.8 ± 0.3
RUN268	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-f7918075-4_1		sdf	pdb	0.8 ± 0.2
RUN469	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-2_1		sdf	pdb	0.8 ± 0.4
RUN347	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-8_1		sdf	pdb	0.8 ± 0.3
RUN407	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-6_2		sdf	pdb	0.8 ± 0.3
RUN699	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-9_1		sdf	pdb	0.8 ± 0.2
RUN154	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-3_2		sdf	pdb	0.8 ± 0.3
RUN476	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-9_1		sdf	pdb	0.8 ± 0.7
RUN42	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-2eddb1ff-5_1		sdf	pdb	0.9 ± 0.2
RUN129	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-1_1		sdf	pdb	0.9 ± 0.2
RUN714	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-b1ef24dc-4_1		sdf	pdb	0.9 ± 0.1
RUN619	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-a13804f0-1_4		sdf	pdb	0.9 ± 0.3
RUN651	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-21_1		sdf	pdb	0.9 ± 0.1
RUN429	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-9_8		sdf	pdb	0.9 ± 0.4
RUN45	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-10_1		sdf	pdb	1.0 ± 0.1
RUN744	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-28_1		sdf	pdb	1.0 ± 0.3
RUN643	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-24_1		sdf	pdb	1.0 ± 0.2
RUN690	ADA-UCB-6c2cb422-1_1		sdf	pdb	ROB-UNI-daaf9793-4_1		sdf	pdb	1.0 ± 0.2
RUN710	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-e274cad4-1_1		sdf	pdb	1.0 ± 0.3
RUN615	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-12_2		sdf	pdb	1.0 ± 0.3
RUN132	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-6ca90168-23_1		sdf	pdb	1.0 ± 0.2
RUN446	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-12_6		sdf	pdb	1.0 ± 0.3
RUN623	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-3_1		sdf	pdb	1.1 ± 0.5
RUN654	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-22_1		sdf	pdb	1.1 ± 0.1
RUN181	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-3b848b35-3_1		sdf	pdb	1.1 ± 0.2
RUN471	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-4_1		sdf	pdb	1.1 ± 0.2
RUN663	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-11_1		sdf	pdb	1.1 ± 0.2
RUN503	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-1_1		sdf	pdb	1.1 ± 0.2
RUN24	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-4_1		sdf	pdb	1.1 ± 0.1
RUN353	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-1_2		sdf	pdb	1.1 ± 0.5
RUN77	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-18_1		sdf	pdb	1.2 ± 0.2
RUN375	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_5		sdf	pdb	1.2 ± 0.2
RUN540	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-9_1		sdf	pdb	1.2 ± 0.4
RUN667	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-20_1		sdf	pdb	1.2 ± 0.2
RUN580	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-6_2		sdf	pdb	1.2 ± 0.3
RUN735	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-7f7e354d-7_1		sdf	pdb	1.2 ± 0.2
RUN694	ADA-UCB-6c2cb422-1_1		sdf	pdb	BEN-DND-02317c5c-8_1		sdf	pdb	1.2 ± 0.2
RUN481	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-16_1		sdf	pdb	1.2 ± 0.3
RUN270	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-f7918075-7_1		sdf	pdb	1.2 ± 0.4
RUN585	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-10_2		sdf	pdb	1.2 ± 0.3
RUN616	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-a13804f0-1_1		sdf	pdb	1.2 ± 0.5
RUN636	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-12_1		sdf	pdb	1.2 ± 0.2
RUN120	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-0f94fc3d-38_2		sdf	pdb	1.2 ± 0.2
RUN252	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-90e38439-1_1		sdf	pdb	1.2 ± 0.2
RUN629	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-7_1		sdf	pdb	1.2 ± 0.2
RUN149	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-12_1		sdf	pdb	1.3 ± 0.2
RUN134	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-7_1		sdf	pdb	1.3 ± 0.2
RUN410	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-4_7		sdf	pdb	1.3 ± 0.4
RUN133	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-1_2		sdf	pdb	1.3 ± 0.3
RUN179	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UCB-6c2cb422-9_1		sdf	pdb	1.3 ± 0.5
RUN267	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-f7918075-6_1		sdf	pdb	1.33 ± 0.07
RUN318	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-UNI-44c99a80-4_1		sdf	pdb	1.3 ± 0.6
RUN430	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-9_7		sdf	pdb	1.3 ± 0.5
RUN609	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-4_3		sdf	pdb	1.4 ± 0.3
RUN185	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-50fe53e8-2_1		sdf	pdb	1.38 ± 0.06
RUN494	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-6_1		sdf	pdb	1.4 ± 0.4
RUN428	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-9_6		sdf	pdb	1.4 ± 0.5
RUN677	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-15_1		sdf	pdb	1.4 ± 0.2
RUN514	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-11_1		sdf	pdb	1.4 ± 0.4
RUN634	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-14_1		sdf	pdb	1.4 ± 0.2
RUN136	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-7_2		sdf	pdb	1.5 ± 0.2
RUN412	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-5_8		sdf	pdb	1.5 ± 0.5
RUN59	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-5_1		sdf	pdb	1.5 ± 0.2
RUN36	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-15_1		sdf	pdb	1.5 ± 0.2
RUN80	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-16_1		sdf	pdb	1.5 ± 0.1
RUN541	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-8_1		sdf	pdb	1.5 ± 0.2
RUN172	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-42806bd5-2_2		sdf	pdb	1.5 ± 0.3
RUN683	ADA-UCB-6c2cb422-1_1		sdf	pdb	ROB-UNI-daaf9793-1_1		sdf	pdb	1.5 ± 0.2
RUN647	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-1_1		sdf	pdb	1.5 ± 0.3
RUN554	ADA-UCB-6c2cb422-1_1		sdf	pdb	RAL-THA-2d450e86-22_1		sdf	pdb	1.5 ± 0.2
RUN290	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-8b8a49e1-5_2		sdf	pdb	1.5 ± 0.4
RUN570	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-50ce7ec3-5_1		sdf	pdb	1.6 ± 0.5
RUN696	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-4_1		sdf	pdb	1.6 ± 0.3
RUN25	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UNI-f8e79267-11_2		sdf	pdb	1.6 ± 0.4
RUN368	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-9_4		sdf	pdb	1.6 ± 0.3
RUN558	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-abfda500-5_1		sdf	pdb	1.6 ± 0.2
RUN385	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_7		sdf	pdb	1.7 ± 0.4
RUN701	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-8_1		sdf	pdb	1.7 ± 0.3
RUN621	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-4_1		sdf	pdb	1.7 ± 0.2
RUN442	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-12_4		sdf	pdb	1.7 ± 0.3
RUN709	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-e274cad4-6_1		sdf	pdb	1.7 ± 0.2
RUN395	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_12		sdf	pdb	1.7 ± 0.4
RUN261	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-4_1		sdf	pdb	1.7 ± 0.2
RUN209	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-8df914d1-3_1		sdf	pdb	1.7 ± 0.3
RUN47	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-4_1		sdf	pdb	1.7 ± 0.3
RUN33	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-7_2		sdf	pdb	1.7 ± 0.4
RUN589	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-11_2		sdf	pdb	1.7 ± 0.4
RUN490	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-9_3		sdf	pdb	1.7 ± 0.2
RUN3	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-714a760b-15_2		sdf	pdb	1.7 ± 0.2
RUN89	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAG-UCB-a3ef7265-9_1		sdf	pdb	1.7 ± 0.2
RUN287	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-8b8a49e1-8_1		sdf	pdb	1.8 ± 0.5
RUN135	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAD-SAT-1b030f84-3_1		sdf	pdb	1.8 ± 0.4
RUN691	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-2_1		sdf	pdb	1.8 ± 0.3
RUN44	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-95b75b4d-7_1		sdf	pdb	1.8 ± 0.3
RUN693	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-1_1		sdf	pdb	1.8 ± 0.2
RUN544	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-12_1		sdf	pdb	1.8 ± 0.2
RUN660	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-9_1		sdf	pdb	1.8 ± 0.2
RUN337	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-d935700b-1_1		sdf	pdb	1.8 ± 0.3
RUN630	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-10_1		sdf	pdb	1.8 ± 0.2
RUN41	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-95b75b4d-8_1		sdf	pdb	1.9 ± 0.2
RUN372	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-9_2		sdf	pdb	1.9 ± 0.3
RUN726	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-5_1		sdf	pdb	1.9 ± 0.3
RUN495	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-8_2		sdf	pdb	1.9 ± 0.2
RUN391	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_14		sdf	pdb	1.9 ± 0.5
RUN739	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-1320d94d-23_1		sdf	pdb	1.9 ± 0.3
RUN436	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-10_2		sdf	pdb	1.9 ± 0.3
RUN48	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-1_1		sdf	pdb	1.9 ± 0.2
RUN665	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-13_1		sdf	pdb	1.9 ± 0.2
RUN57	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-3_1		sdf	pdb	1.9 ± 0.3
RUN400	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-5_6		sdf	pdb	1.9 ± 0.5
RUN34	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UNI-f8e79267-8_2		sdf	pdb	1.9 ± 0.4
RUN63	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-7_1		sdf	pdb	1.9 ± 0.3
RUN365	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-9_1		sdf	pdb	1.9 ± 0.2
RUN579	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-6_1		sdf	pdb	1.9 ± 0.5
RUN351	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-2_2		sdf	pdb	1.9 ± 0.5
RUN360	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-1_5		sdf	pdb	1.9 ± 0.6
RUN163	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-16_1		sdf	pdb	1.9 ± 0.3
RUN406	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-9_7		sdf	pdb	2.0 ± 0.3
RUN76	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-21_1		sdf	pdb	2.0 ± 0.4
RUN271	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-f7918075-8_1		sdf	pdb	2.0 ± 0.3
RUN289	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-05e51b3f-17_1		sdf	pdb	2.0 ± 0.2
RUN143	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-13_1		sdf	pdb	2.0 ± 0.2
RUN312	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-199e2e7c-1_1		sdf	pdb	2.0 ± 0.2
RUN403	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-5_5		sdf	pdb	2.0 ± 0.5
RUN190	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-e1b5ac6b-1_1		sdf	pdb	2.0 ± 0.3
RUN241	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-1dbca3b4-1_1		sdf	pdb	2.0 ± 0.3
RUN378	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_8		sdf	pdb	2.0 ± 0.4
RUN243	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-d36ab305-4_1		sdf	pdb	2.0 ± 0.3
RUN6	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UNI-f8e79267-10_1		sdf	pdb	2.0 ± 0.3
RUN431	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-7_6		sdf	pdb	2.0 ± 0.7
RUN633	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-4_1		sdf	pdb	2.0 ± 0.1
RUN596	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-14_1		sdf	pdb	2.1 ± 0.5
RUN397	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-9_8		sdf	pdb	2.1 ± 0.3
RUN692	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-5_1		sdf	pdb	2.1 ± 0.3
RUN40	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-95b75b4d-5_1		sdf	pdb	2.1 ± 0.2
RUN669	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-20_2		sdf	pdb	2.1 ± 0.2
RUN198	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-a364e151-2_1		sdf	pdb	2.1 ± 0.2
RUN626	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-2_1		sdf	pdb	2.1 ± 0.3
RUN91	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-49816e9b-3_1		sdf	pdb	2.1 ± 0.3
RUN717	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-158bee2a-1_1		sdf	pdb	2.1 ± 0.2
RUN83	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-49816e9b-2_1		sdf	pdb	2.1 ± 0.2
RUN325	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-14_2		sdf	pdb	2.1 ± 0.5
RUN197	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-a364e151-3_1		sdf	pdb	2.1 ± 0.2
RUN199	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-976da9a6-1_1		sdf	pdb	2.1 ± 0.2
RUN67	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-2_1		sdf	pdb	2.2 ± 0.2
RUN425	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-9_5		sdf	pdb	2.2 ± 0.4
RUN376	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_2		sdf	pdb	2.2 ± 0.3
RUN613	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-4_2		sdf	pdb	2.2 ± 0.4
RUN343	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-7bb79bc5-1_1		sdf	pdb	2.2 ± 0.2
RUN130	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-6ca90168-24_1		sdf	pdb	2.2 ± 0.3
RUN233	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-5_3		sdf	pdb	2.2 ± 0.2
RUN170	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-e1818702-8_1		sdf	pdb	2.2 ± 0.2
RUN519	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-3_1		sdf	pdb	2.2 ± 0.6
RUN5	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-714a760b-18_2		sdf	pdb	2.2 ± 0.2
RUN234	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-4_7		sdf	pdb	2.2 ± 0.2
RUN297	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-3_1		sdf	pdb	2.2 ± 0.3
RUN573	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-7_1		sdf	pdb	2.2 ± 0.3
RUN499	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-5_4		sdf	pdb	2.2 ± 0.4
RUN188	ADA-UCB-6c2cb422-1_1		sdf	pdb	WIL-UNI-2e73223c-4_1		sdf	pdb	2.2 ± 0.5
RUN61	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-23_1		sdf	pdb	2.2 ± 0.2
RUN559	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-abfda500-4_1		sdf	pdb	2.3 ± 0.3
RUN4	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-714a760b-3_1		sdf	pdb	2.3 ± 0.2
RUN502	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-6_4		sdf	pdb	2.3 ± 0.7
RUN141	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-5_1		sdf	pdb	2.3 ± 0.2
RUN46	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-11_1		sdf	pdb	2.3 ± 0.3
RUN638	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-18_1		sdf	pdb	2.3 ± 0.2
RUN746	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-6e43a462-2_1		sdf	pdb	2.3 ± 0.4
RUN316	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-e44ffd04-1_1		sdf	pdb	2.3 ± 0.2
RUN124	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-20_2		sdf	pdb	2.3 ± 0.3
RUN401	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_15		sdf	pdb	2.3 ± 0.3
RUN12	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UNI-f8e79267-7_2		sdf	pdb	2.4 ± 0.4
RUN657	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-7_1		sdf	pdb	2.4 ± 0.2
RUN293	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-05e51b3f-16_1		sdf	pdb	2.4 ± 0.3
RUN411	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-5_7		sdf	pdb	2.4 ± 0.5
RUN379	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-9_5		sdf	pdb	2.4 ± 0.2
RUN84	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-5_2		sdf	pdb	2.4 ± 0.3
RUN388	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_10		sdf	pdb	2.4 ± 0.4
RUN191	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-a364e151-1_1		sdf	pdb	2.4 ± 0.3
RUN148	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-66895286-1_1		sdf	pdb	2.4 ± 0.2
RUN229	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-5_1		sdf	pdb	2.4 ± 0.2
RUN274	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-6ab519a7-1_2		sdf	pdb	2.4 ± 0.4
RUN329	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-12_1		sdf	pdb	2.4 ± 0.2
RUN339	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-50cce87d-4_1		sdf	pdb	2.4 ± 0.3
RUN588	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UNK-9a7dc93f-7_2		sdf	pdb	2.4 ± 0.2
RUN459	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-6fede743-5_1		sdf	pdb	2.4 ± 0.3
RUN298	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-2_1		sdf	pdb	2.4 ± 0.3
RUN533	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-13_1		sdf	pdb	2.4 ± 0.3
RUN381	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-7_3		sdf	pdb	2.4 ± 0.8
RUN138	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-6_1		sdf	pdb	2.5 ± 0.2
RUN408	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-1_4		sdf	pdb	2.5 ± 0.6
RUN543	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-4_1		sdf	pdb	2.5 ± 0.3
RUN8	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UNI-f8e79267-10_2		sdf	pdb	2.5 ± 0.4
RUN477	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-8_1		sdf	pdb	2.5 ± 0.4
RUN336	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-6_1		sdf	pdb	2.5 ± 0.4
RUN539	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-56cf811e-5_1		sdf	pdb	2.5 ± 0.6
RUN13	ADA-UCB-6c2cb422-1_1		sdf	pdb	AGN-NEW-c7b24fe3-5_1		sdf	pdb	2.5 ± 0.2
RUN55	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-5a013bed-8_1		sdf	pdb	2.6 ± 0.4
RUN682	ADA-UCB-6c2cb422-1_1		sdf	pdb	ROB-UNI-daaf9793-2_2		sdf	pdb	2.6 ± 0.6
RUN196	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-50fe53e8-3_1		sdf	pdb	2.6 ± 0.2
RUN475	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-10_1		sdf	pdb	2.6 ± 0.3
RUN485	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-9_1		sdf	pdb	2.6 ± 0.2
RUN167	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-e1818702-7_1		sdf	pdb	2.6 ± 0.3
RUN470	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-1_1		sdf	pdb	2.6 ± 0.5
RUN82	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-10_1		sdf	pdb	2.6 ± 0.6
RUN21	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-6_1		sdf	pdb	2.6 ± 0.3
RUN184	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-50fe53e8-1_1		sdf	pdb	2.6 ± 0.2
RUN320	ADA-UCB-6c2cb422-1_1		sdf	pdb	RIT-UNK-fa3975ff-1_2		sdf	pdb	2.6 ± 0.4
RUN314	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-16_1		sdf	pdb	2.6 ± 0.2
RUN68	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-d851b096-1_1		sdf	pdb	2.6 ± 0.3
RUN176	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-e1818702-10_1		sdf	pdb	2.6 ± 0.2
RUN563	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-50ce7ec3-6_1		sdf	pdb	2.6 ± 0.7
RUN545	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-13_1		sdf	pdb	2.7 ± 0.3
RUN307	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-9_1		sdf	pdb	2.7 ± 0.2
RUN137	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-5_2		sdf	pdb	2.7 ± 0.2
RUN85	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-15_1		sdf	pdb	2.7 ± 0.5
RUN253	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-90e38439-3_2		sdf	pdb	2.7 ± 0.4
RUN553	ADA-UCB-6c2cb422-1_1		sdf	pdb	NIR-THE-590dedc7-1_2		sdf	pdb	2.7 ± 0.4
RUN125	ADA-UCB-6c2cb422-1_1		sdf	pdb	ANN-UNI-98d2bf15-3_1		sdf	pdb	2.7 ± 0.2
RUN116	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-4_2		sdf	pdb	2.7 ± 0.4
RUN72	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-13_1		sdf	pdb	2.7 ± 0.1
RUN520	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-2_1		sdf	pdb	2.7 ± 0.3
RUN698	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-6_1		sdf	pdb	2.7 ± 0.3
RUN215	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-8df914d1-4_1		sdf	pdb	2.8 ± 0.6
RUN302	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-12_1		sdf	pdb	2.8 ± 0.2
RUN688	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UNK-411a133b-2_1		sdf	pdb	2.8 ± 0.3
RUN522	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-12_1		sdf	pdb	2.8 ± 0.3
RUN216	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-c66144cb-3_1		sdf	pdb	2.8 ± 0.4
RUN53	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-5_1		sdf	pdb	2.8 ± 0.4
RUN65	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-10_1		sdf	pdb	2.8 ± 0.3
RUN646	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-9_1		sdf	pdb	2.8 ± 0.2
RUN98	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAG-UCB-a3ef7265-15_1		sdf	pdb	2.9 ± 0.2
RUN0	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-714a760b-15_1		sdf	pdb	2.9 ± 0.4
RUN155	ADA-UCB-6c2cb422-1_1		sdf	pdb	BRU-CON-67e07230-1_2		sdf	pdb	2.9 ± 0.2
RUN656	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-5_1		sdf	pdb	2.87 ± 0.06
RUN549	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-6_1		sdf	pdb	2.9 ± 0.3
RUN666	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-19_1		sdf	pdb	2.9 ± 0.2
RUN99	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAG-UCB-a3ef7265-17_1		sdf	pdb	2.9 ± 0.3
RUN614	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-4_1		sdf	pdb	2.9 ± 0.4
RUN618	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-a13804f0-1_2		sdf	pdb	2.9 ± 0.4
RUN560	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-fce787c2-1_1		sdf	pdb	2.9 ± 0.3
RUN371	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_4		sdf	pdb	2.9 ± 0.3
RUN282	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-05e51b3f-2_1		sdf	pdb	2.9 ± 0.4
RUN511	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-56cf811e-2_1		sdf	pdb	2.9 ± 0.3
RUN516	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-8_1		sdf	pdb	2.9 ± 0.2
RUN164	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-42806bd5-2_1		sdf	pdb	2.9 ± 0.4
RUN464	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-6_1		sdf	pdb	3.0 ± 0.2
RUN86	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-49816e9b-5_1		sdf	pdb	3.0 ± 0.3
RUN330	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-2_2		sdf	pdb	3.0 ± 0.4
RUN43	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-2eddb1ff-4_1		sdf	pdb	3.0 ± 0.3
RUN370	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_6		sdf	pdb	3.0 ± 0.4
RUN242	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-d36ab305-1_2		sdf	pdb	3.0 ± 0.3
RUN348	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-3_1		sdf	pdb	3.0 ± 0.3
RUN697	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-7_1		sdf	pdb	3.0 ± 0.2
RUN313	ADA-UCB-6c2cb422-1_1		sdf	pdb	RIT-UNK-fa3975ff-1_1		sdf	pdb	3.0 ± 0.2
RUN523	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-1_1		sdf	pdb	3.0 ± 0.3
RUN213	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-0bc33984-2_1		sdf	pdb	3.1 ± 0.3
RUN517	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-13_1		sdf	pdb	3.1 ± 0.7
RUN493	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-5_1		sdf	pdb	3.1 ± 0.5
RUN250	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-90e38439-3_1		sdf	pdb	3.1 ± 0.4
RUN96	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAG-UCB-a3ef7265-8_1		sdf	pdb	3.1 ± 0.2
RUN604	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-15_2		sdf	pdb	3.1 ± 0.4
RUN186	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-e1818702-4_1		sdf	pdb	3.1 ± 0.2
RUN399	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-9_6		sdf	pdb	3.1 ± 0.3
RUN35	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-3_2		sdf	pdb	3.1 ± 0.2
RUN456	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-6fede743-4_1		sdf	pdb	3.2 ± 0.2
RUN662	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-16_2		sdf	pdb	3.2 ± 0.3
RUN382	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-7_4		sdf	pdb	3.2 ± 0.8
RUN386	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-4_2		sdf	pdb	3.2 ± 0.5
RUN173	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-3fc1724e-8_1		sdf	pdb	3.2 ± 0.6
RUN162	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-42806bd5-1_2		sdf	pdb	3.2 ± 0.3
RUN722	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-a9ad2217-2_2		sdf	pdb	3.2 ± 0.4
RUN718	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-158bee2a-3_1		sdf	pdb	3.3 ± 0.2
RUN150	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-3_1		sdf	pdb	3.3 ± 0.5
RUN223	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-4_1		sdf	pdb	3.3 ± 0.2
RUN153	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-00f2c2b3-7_1		sdf	pdb	3.3 ± 0.1
RUN2	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-714a760b-6_1		sdf	pdb	3.3 ± 0.3
RUN534	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-2_1		sdf	pdb	3.4 ± 0.3
RUN292	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-8b8a49e1-6_2		sdf	pdb	3.4 ± 0.2
RUN664	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-16_1		sdf	pdb	3.4 ± 0.2
RUN341	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-d935700b-2_1		sdf	pdb	3.4 ± 0.3
RUN285	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-05e51b3f-2_2		sdf	pdb	3.4 ± 0.4
RUN224	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-4_3		sdf	pdb	3.4 ± 0.2
RUN254	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-90e38439-2_2		sdf	pdb	3.5 ± 0.3
RUN259	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-6_1		sdf	pdb	3.5 ± 0.3
RUN78	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-17_1		sdf	pdb	3.5 ± 0.3
RUN331	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-3_1		sdf	pdb	3.5 ± 0.5
RUN37	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-3_1		sdf	pdb	3.5 ± 0.3
RUN11	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UNI-f8e79267-7_1		sdf	pdb	3.5 ± 0.5
RUN488	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-8_3		sdf	pdb	3.5 ± 0.6
RUN680	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-21_2		sdf	pdb	3.5 ± 0.7
RUN532	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-6_1		sdf	pdb	3.5 ± 0.2
RUN205	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-976da9a6-2_1		sdf	pdb	3.5 ± 0.3
RUN238	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-4_8		sdf	pdb	3.5 ± 0.3
RUN27	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-10_1		sdf	pdb	3.6 ± 0.3
RUN192	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-3b848b35-4_1		sdf	pdb	3.6 ± 0.3
RUN346	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-3_2		sdf	pdb	3.6 ± 0.4
RUN7	ADA-UCB-6c2cb422-1_1		sdf	pdb	AGN-NEW-c7b24fe3-1_1		sdf	pdb	3.6 ± 0.2
RUN14	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-1_2		sdf	pdb	3.6 ± 0.3
RUN258	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-5_1		sdf	pdb	3.7 ± 0.1
RUN97	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAG-UCB-a3ef7265-4_1		sdf	pdb	3.7 ± 0.2
RUN236	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-5_6		sdf	pdb	3.7 ± 0.4
RUN38	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-10_2		sdf	pdb	3.7 ± 0.2
RUN228	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-4_6		sdf	pdb	3.7 ± 0.3
RUN235	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-5_7		sdf	pdb	3.7 ± 0.2
RUN161	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-e1818702-1_1		sdf	pdb	3.7 ± 0.2
RUN500	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-7_1		sdf	pdb	3.7 ± 0.4
RUN126	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-22_2		sdf	pdb	3.7 ± 0.6
RUN489	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-9_2		sdf	pdb	3.7 ± 0.2
RUN706	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UNK-4cf5aa07-1_1		sdf	pdb	3.7 ± 0.2
RUN183	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-0c2c77e1-1_1		sdf	pdb	3.8 ± 0.3
RUN142	ADA-UCB-6c2cb422-1_1		sdf	pdb	SAM-UNK-2684b532-11_1		sdf	pdb	3.8 ± 0.2
RUN286	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-8b8a49e1-5_1		sdf	pdb	3.8 ± 0.3
RUN28	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UNI-f8e79267-8_1		sdf	pdb	3.8 ± 0.3
RUN512	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-9_1		sdf	pdb	3.8 ± 0.3
RUN308	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-10_1		sdf	pdb	3.8 ± 0.2
RUN305	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-11_1		sdf	pdb	3.8 ± 0.2
RUN565	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-50ce7ec3-4_1		sdf	pdb	3.8 ± 0.8
RUN309	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-14_1		sdf	pdb	3.8 ± 0.2
RUN212	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-8df914d1-2_1		sdf	pdb	3.8 ± 0.3
RUN458	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-6fede743-2_1		sdf	pdb	3.9 ± 0.3
RUN491	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-8_1		sdf	pdb	3.9 ± 0.2
RUN530	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-4_1		sdf	pdb	3.9 ± 0.3
RUN93	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAG-UCB-a3ef7265-2_1		sdf	pdb	3.9 ± 0.3
RUN659	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-7_2		sdf	pdb	3.9 ± 0.2
RUN332	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-UNI-44c99a80-1_1		sdf	pdb	3.9 ± 0.3
RUN452	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-32_1		sdf	pdb	3.9 ± 0.2
RUN642	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-cf4b0d25-2_2		sdf	pdb	3.9 ± 0.6
RUN419	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-8_2		sdf	pdb	4.0 ± 0.5
RUN333	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-11_1		sdf	pdb	4.0 ± 0.2
RUN182	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-ddb41b15-9_2		sdf	pdb	4.0 ± 0.6
RUN73	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-14_1		sdf	pdb	4.0 ± 0.2
RUN398	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-3_16		sdf	pdb	4.0 ± 0.3
RUN160	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-f4ca5a00-12_1		sdf	pdb	4.0 ± 0.2
RUN208	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-0bc33984-1_2		sdf	pdb	4.1 ± 0.2
RUN32	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-16_1		sdf	pdb	4.1 ± 0.2
RUN645	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-20_1		sdf	pdb	4.1 ± 0.4
RUN88	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-5_1		sdf	pdb	4.1 ± 0.5
RUN508	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-6_2		sdf	pdb	4.1 ± 0.4
RUN217	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-0bc33984-2_2		sdf	pdb	4.2 ± 0.3
RUN686	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f92d7c0c-3_1		sdf	pdb	4.2 ± 0.3
RUN742	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-6e43a462-1_1		sdf	pdb	4.2 ± 0.6
RUN291	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-8b8a49e1-7_2		sdf	pdb	4.2 ± 0.3
RUN631	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-8_1		sdf	pdb	4.2 ± 0.2
RUN232	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-5_4		sdf	pdb	4.2 ± 0.6
RUN113	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-12_2		sdf	pdb	4.2 ± 0.6
RUN538	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-56cf811e-6_1		sdf	pdb	4.2 ± 0.7
RUN156	ADA-UCB-6c2cb422-1_1		sdf	pdb	BRU-CON-67e07230-1_1		sdf	pdb	4.2 ± 0.3
RUN122	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-21_2		sdf	pdb	4.2 ± 0.4
RUN671	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-23_1		sdf	pdb	4.3 ± 0.4
RUN1	ADA-UCB-6c2cb422-1_1		sdf	pdb	TRY-UNI-714a760b-18_1		sdf	pdb	4.3 ± 0.3
RUN31	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-22_1		sdf	pdb	4.3 ± 0.4
RUN54	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-3_1		sdf	pdb	4.3 ± 0.3
RUN211	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-0bc33984-1_3		sdf	pdb	4.3 ± 0.2
RUN668	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-22_1		sdf	pdb	4.3 ± 0.3
RUN230	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-5_2		sdf	pdb	4.3 ± 0.3
RUN249	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-90e38439-2_1		sdf	pdb	4.3 ± 0.2
RUN180	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAR-TRE-f6f5f473-93_1		sdf	pdb	4.4 ± 0.4
RUN94	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAG-UCB-a3ef7265-5_1		sdf	pdb	4.4 ± 0.2
RUN295	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-8b8a49e1-7_1		sdf	pdb	4.4 ± 0.3
RUN323	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-13_1		sdf	pdb	4.4 ± 0.3
RUN504	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-9_4		sdf	pdb	4.5 ± 0.2
RUN417	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-6_2		sdf	pdb	4.5 ± 0.3
RUN457	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-6fede743-1_1		sdf	pdb	4.5 ± 0.5
RUN455	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-6fede743-3_1		sdf	pdb	4.5 ± 0.3
RUN169	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-e1818702-9_1		sdf	pdb	4.5 ± 0.5
RUN568	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-50ce7ec3-3_1		sdf	pdb	4.5 ± 0.8
RUN632	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-6_1		sdf	pdb	4.5 ± 0.3
RUN496	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-a38a7bdd-5_2		sdf	pdb	4.5 ± 0.5
RUN207	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-0bc33984-1_1		sdf	pdb	4.5 ± 0.2
RUN177	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-fc94cdb5-1_1		sdf	pdb	4.6 ± 0.2
RUN644	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-23_1		sdf	pdb	4.6 ± 0.3
RUN239	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-1dbca3b4-1_2		sdf	pdb	4.6 ± 0.3
RUN118	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-14_1		sdf	pdb	4.6 ± 0.8
RUN605	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-ee07cf00-5_2		sdf	pdb	4.6 ± 0.7
RUN266	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-4211dce8-1_1		sdf	pdb	4.6 ± 0.3
RUN548	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-7_1		sdf	pdb	4.6 ± 0.6
RUN681	ADA-UCB-6c2cb422-1_1		sdf	pdb	ROB-UNI-daaf9793-2_1		sdf	pdb	4.6 ± 0.7
RUN562	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-50ce7ec3-1_1		sdf	pdb	4.6 ± 0.4
RUN9	ADA-UCB-6c2cb422-1_1		sdf	pdb	AGN-NEW-c7b24fe3-4_1		sdf	pdb	4.7 ± 0.2
RUN327	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-14_1		sdf	pdb	4.7 ± 0.7
RUN687	ADA-UCB-6c2cb422-1_1		sdf	pdb	ROB-UNI-daaf9793-4_2		sdf	pdb	4.7 ± 0.5
RUN321	ADA-UCB-6c2cb422-1_1		sdf	pdb	VLA-UCB-05e51b3f-3_1		sdf	pdb	4.7 ± 0.5
RUN225	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-4_4		sdf	pdb	4.8 ± 0.5
RUN166	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-42806bd5-1_1		sdf	pdb	4.8 ± 0.2
RUN326	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-13_2		sdf	pdb	4.9 ± 0.2
RUN174	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-4c7b8ba7-1_1		sdf	pdb	4.9 ± 0.1
RUN328	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-3_2		sdf	pdb	4.9 ± 0.3
RUN280	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-500ca5bf-2_1		sdf	pdb	5.0 ± 0.3
RUN361	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-5_2		sdf	pdb	5.0 ± 0.4
RUN306	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-5_1		sdf	pdb	5.0 ± 0.4
RUN246	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-c66144cb-1_1		sdf	pdb	5.0 ± 0.4
RUN56	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-9_1		sdf	pdb	5.1 ± 0.3
RUN103	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-5_2		sdf	pdb	5.1 ± 0.8
RUN175	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-4c7b8ba7-1_2		sdf	pdb	5.1 ± 0.2
RUN675	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-23_2		sdf	pdb	5.2 ± 0.2
RUN263	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-3cc264b0-1_1		sdf	pdb	5.2 ± 0.2
RUN231	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-5_5		sdf	pdb	5.2 ± 0.3
RUN146	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-bbe8d7ff-2_1		sdf	pdb	5.2 ± 0.3
RUN637	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-19_1		sdf	pdb	5.2 ± 0.4
RUN561	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-50ce7ec3-2_1		sdf	pdb	5.3 ± 0.6
RUN256	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-bb423b95-3_1		sdf	pdb	5.3 ± 0.4
RUN526	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-11_1		sdf	pdb	5.3 ± 0.2
RUN527	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-12_1		sdf	pdb	5.3 ± 0.7
RUN58	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-1_1		sdf	pdb	5.3 ± 0.3
RUN449	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-6_2		sdf	pdb	5.4 ± 0.4
RUN404	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-4_1		sdf	pdb	5.4 ± 0.4
RUN357	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-1_6		sdf	pdb	5.4 ± 0.4
RUN51	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-13_1		sdf	pdb	5.4 ± 0.3
RUN303	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-6_1		sdf	pdb	5.5 ± 0.4
RUN707	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-f4e47ebd-1_1		sdf	pdb	5.5 ± 0.3
RUN317	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-c8e7a002-15_1		sdf	pdb	5.5 ± 0.3
RUN127	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-0f94fc3d-38_1		sdf	pdb	5.6 ± 0.3
RUN210	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-0bc33984-1_4		sdf	pdb	5.6 ± 0.2
RUN220	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-2_2		sdf	pdb	5.6 ± 0.7
RUN247	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-c66144cb-2_1		sdf	pdb	5.6 ± 0.3
RUN251	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-90e38439-1_2		sdf	pdb	5.6 ± 0.2
RUN226	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-4_5		sdf	pdb	5.6 ± 0.2
RUN219	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-2_1		sdf	pdb	5.6 ± 0.8
RUN444	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-12_8		sdf	pdb	5.7 ± 0.5
RUN15	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-2_1		sdf	pdb	5.7 ± 0.2
RUN222	ADA-UCB-6c2cb422-1_1		sdf	pdb	PET-UNK-8df914d1-5_1		sdf	pdb	5.7 ± 0.6
RUN10	ADA-UCB-6c2cb422-1_1		sdf	pdb	AGN-NEW-cce853d0-2_1		sdf	pdb	5.7 ± 0.5
RUN438	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-11_1		sdf	pdb	5.8 ± 0.5
RUN237	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-5_8		sdf	pdb	5.9 ± 0.2
RUN364	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-1_2		sdf	pdb	5.9 ± 0.4
RUN546	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-10_1		sdf	pdb	5.9 ± 0.3
RUN187	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-ddb41b15-9_1		sdf	pdb	5.9 ± 0.4
RUN550	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-3fc3434e-11_1		sdf	pdb	5.9 ± 0.2
RUN377	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-4_1		sdf	pdb	5.9 ± 0.4
RUN71	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-11_1		sdf	pdb	6.0 ± 0.5
RUN123	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-20_1		sdf	pdb	6.1 ± 0.4
RUN448	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-67d4a29a-3_1		sdf	pdb	6.2 ± 0.4
RUN227	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-8373f97b-4_2		sdf	pdb	6.2 ± 0.2
RUN30	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-9_2		sdf	pdb	6.2 ± 0.4
RUN359	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-4_4		sdf	pdb	6.3 ± 0.5
RUN26	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UNI-f8e79267-11_1		sdf	pdb	6.3 ± 0.3
RUN81	ADA-UCB-6c2cb422-1_1		sdf	pdb	BAR-COM-ebf5acce-6_1		sdf	pdb	6.3 ± 0.4
RUN441	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-12_2		sdf	pdb	6.4 ± 0.4
RUN16	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-1_1		sdf	pdb	6.4 ± 0.3
RUN109	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-2_2		sdf	pdb	6.4 ± 0.4
RUN366	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-1_1		sdf	pdb	6.4 ± 0.3
RUN294	ADA-UCB-6c2cb422-1_1		sdf	pdb	ALP-POS-8b8a49e1-8_2		sdf	pdb	6.4 ± 0.7
RUN384	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-4_3		sdf	pdb	6.5 ± 0.6
RUN463	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-22_2		sdf	pdb	6.5 ± 0.4
RUN628	ADA-UCB-6c2cb422-1_1		sdf	pdb	JIN-POS-6dc588a4-5_1		sdf	pdb	6.6 ± 0.3
RUN525	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-10_1		sdf	pdb	6.7 ± 0.4
RUN324	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-10_1		sdf	pdb	6.8 ± 0.3
RUN531	ADA-UCB-6c2cb422-1_1		sdf	pdb	JOH-UNI-ee5ed7c8-7_1		sdf	pdb	6.8 ± 0.3
RUN342	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-97c1bf5c-1_1		sdf	pdb	7.0 ± 0.3
RUN281	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-13557a72-1_1		sdf	pdb	7.1 ± 0.5
RUN165	ADA-UCB-6c2cb422-1_1		sdf	pdb	ADA-UCB-6c2cb422-10_1		sdf	pdb	7.2 ± 0.5
RUN273	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAT-POS-1e5f28a7-1_2		sdf	pdb	7.2 ± 0.4
RUN676	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-24_2		sdf	pdb	7.3 ± 0.5
RUN355	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-2_4		sdf	pdb	7.3 ± 0.3
RUN658	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-6_2		sdf	pdb	7.4 ± 0.5
RUN472	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-22_3		sdf	pdb	7.4 ± 0.6
RUN678	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-24_1		sdf	pdb	7.5 ± 0.3
RUN193	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDJ-MED-50fe53e8-4_1		sdf	pdb	7.5 ± 0.4
RUN424	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-9_4		sdf	pdb	7.5 ± 0.4
RUN17	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-5_1		sdf	pdb	7.7 ± 0.4
RUN679	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-21_1		sdf	pdb	7.8 ± 0.6
RUN70	ADA-UCB-6c2cb422-1_1		sdf	pdb	EDG-MED-0da5ad92-12_1		sdf	pdb	7.9 ± 0.2
RUN369	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-4_2		sdf	pdb	7.9 ± 0.4
RUN23	ADA-UCB-6c2cb422-1_1		sdf	pdb	JAN-GHE-83b26c96-8_1		sdf	pdb	8.0 ± 0.2
RUN552	ADA-UCB-6c2cb422-1_1		sdf	pdb	NIR-THE-590dedc7-1_1		sdf	pdb	8.1 ± 0.3
RUN652	ADA-UCB-6c2cb422-1_1		sdf	pdb	RUB-POS-1325a9ea-6_1		sdf	pdb	8.1 ± 0.7
RUN695	ADA-UCB-6c2cb422-1_1		sdf	pdb	BEN-DND-02317c5c-9_1		sdf	pdb	8.2 ± 0.2
RUN426	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-7_3		sdf	pdb	8.2 ± 0.4
RUN465	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-c749d764-22_1		sdf	pdb	8.2 ± 0.5
RUN128	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-22_1		sdf	pdb	8.6 ± 0.3
RUN409	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-5_4		sdf	pdb	8.7 ± 0.3
RUN283	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-13557a72-1_2		sdf	pdb	8.8 ± 0.7
RUN418	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-7_2		sdf	pdb	9.1 ± 0.3
RUN422	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-9_1		sdf	pdb	9.1 ± 0.3
RUN276	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-6ab519a7-1_1		sdf	pdb	9.2 ± 0.3
RUN414	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-6_1		sdf	pdb	9.3 ± 0.4
RUN423	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-9_3		sdf	pdb	9.3 ± 0.4
RUN380	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-5_1		sdf	pdb	9.5 ± 0.3
RUN437	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-10_1		sdf	pdb	9.6 ± 0.3
RUN373	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-2_6		sdf	pdb	9.6 ± 0.3
RUN131	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-21_1		sdf	pdb	9.8 ± 0.3
RUN102	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-f203cb68-5_1		sdf	pdb	9.9 ± 0.5
RUN394	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-5_2		sdf	pdb	10.0 ± 0.3
RUN383	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-5_3		sdf	pdb	10.0 ± 0.4
RUN319	ADA-UCB-6c2cb422-1_1		sdf	pdb	NAU-LAT-a5c7d7cb-2_1		sdf	pdb	10.3 ± 0.3
RUN434	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-7_4		sdf	pdb	10.4 ± 0.5
RUN529	ADA-UCB-6c2cb422-1_1		sdf	pdb	DAR-DIA-076fb6ea-14_1		sdf	pdb	10.5 ± 0.7
RUN367	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-7_2		sdf	pdb	10.7 ± 0.7
RUN354	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-1_4		sdf	pdb	10.8 ± 0.4
RUN427	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-11_2		sdf	pdb	10.9 ± 0.4
RUN421	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-9_2		sdf	pdb	10.9 ± 0.3
RUN420	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-8_1		sdf	pdb	11.9 ± 0.4
RUN374	ADA-UCB-6c2cb422-1_1		sdf	pdb	MAK-UNK-ffc90da7-7_1		sdf	pdb	13.0 ± 0.9
RUN416	ADA-UCB-6c2cb422-1_1		sdf	pdb	MIC-UNK-5a93dd5f-7_1		sdf	pdb	14.6 ± 0.4